ergo
hermite_conversion_symb.cc File Reference

Code for conversion between integrals computed for Hermite Gaussians and Cartesian Gaussians, using a symbolic conversion matrix. More...

#include <stdlib.h>
#include <memory.h>
#include <assert.h>
#include "hermite_conversion_symb.h"

Classes

struct  poly_1d_term_struct_symb
 
struct  poly_1d_struct_symb
 
struct  poly_3d_term_struct_symb
 
struct  poly_3d_struct_symb
 

Macros

#define MAX_NO_OF_1D_TERMS   888
 
#define MAX_NO_OF_3D_TERMS   888
 

Functions

static int get_1d_hermite_poly_symb (poly_1d_struct_symb *result, int n)
 
static int get_1d_hermite_poly_inv_symb (poly_1d_struct_symb *result, int n)
 
static int create_3d_poly_from_1d_poly_symb (poly_3d_struct_symb *poly_3d, poly_1d_struct_symb *poly_1d, int coordIndex)
 
static int compute_product_of_3d_polys_symb (poly_3d_struct_symb *result, poly_3d_struct_symb *poly_1, poly_3d_struct_symb *poly_2)
 
int get_hermite_conversion_matrix_symb (const monomial_info_struct *monomial_info, int nmax, int inverseFlag, symb_matrix_element *result)
 

Detailed Description

Code for conversion between integrals computed for Hermite Gaussians and Cartesian Gaussians, using a symbolic conversion matrix.

Author
: Elias Rudberg responsible

Macro Definition Documentation

◆ MAX_NO_OF_1D_TERMS

#define MAX_NO_OF_1D_TERMS   888

◆ MAX_NO_OF_3D_TERMS

#define MAX_NO_OF_3D_TERMS   888

Function Documentation

◆ compute_product_of_3d_polys_symb()

◆ create_3d_poly_from_1d_poly_symb()

◆ get_1d_hermite_poly_inv_symb()

◆ get_1d_hermite_poly_symb()

◆ get_hermite_conversion_matrix_symb()